Phaeosphaeride A; 2-Heptyl analogue, 13-oxo(aldehyde)
AlkaPlorer ID: AK309901
Synonym: Phyllostictine D
IUPAC Name: 2-heptyl-3,4-dihydroxy-6-methoxy-7-methylidene-5-oxo-2,4-dihydropyrano[2,3-c]pyrrole-3-carbaldehyde
Structure
SMILES: C=C1C2=C(C(=O)N1OC)C(O)C(O)(C=O)C(CCCCCCC)O2
InChI: InChI=1S/C17H25NO6/c1-4-5-6-7-8-9-12-17(22,10-19)15(20)13-14(24-12)11(2)18(23-3)16(13)21/h10,12,15,20,22H,2,4-9H2,1,3H3
InChIKey: BENCPPAQDNCVGQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phyllosticta cirsii | Phyllosticta | Phyllostictaceae | Botryosphaeriales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 339.3880000000002
TPSA？: 96.3
MolLogP？: 1.207999999999999
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|